Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n1e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N SER 4.A OG no hydrogen 3.101 N/A SER 4.A N ASP 1.A OD2 no hydrogen 2.742 N/A SER 4.A OG ASP 1.A O no hydrogen 2.979 N/A SER 4.A OG ASP 1.A OD2 no hydrogen 3.024 N/A MET 5.A N ASP 1.A O no hydrogen 2.969 N/A LEU 6.A N GLN 2.A O no hydrogen 3.137 N/A ARG 7.A N TRP 3.A O no hydrogen 2.980 N/A HIS 8.A N SER 4.A O no hydrogen 3.072 N/A PHE 9.A N MET 5.A O no hydrogen 2.898 N/A ASP 10.A N LEU 6.A O no hydrogen 2.763 N/A HIS 11.A N ARG 7.A O no hydrogen 3.048 N/A ILE 12.A N HIS 8.A O no hydrogen 2.942 N/A THR 13.A N PHE 9.A O no hydrogen 3.005 N/A THR 13.A OG1 PHE 9.A O no hydrogen 2.993 N/A LYS 14.A NZ ASP 15.A OD2 no hydrogen 3.330 N/A TYR 16.A N THR 13.A O no hydrogen 2.988 N/A HIS 19.A N ASP 15.A O no hydrogen 2.827 N/A HIS 19.A ND1 GLU 22.A OE1 no hydrogen 3.005 N/A ILE 20.A N TYR 16.A O no hydrogen 2.978 N/A ALA 21.A N HIS 17.A O no hydrogen 3.262 N/A GLU 22.A N ASP 18.A O no hydrogen 3.225 N/A ILE 23.A N HIS 19.A O no hydrogen 3.042 N/A SER 24.A N ILE 20.A O no hydrogen 2.847 N/A SER 24.A OG ILE 20.A O no hydrogen 2.842 N/A ALA 25.A N ALA 21.A O no hydrogen 2.887 N/A LYS 26.A N ILE 23.A O no hydrogen 3.003 N/A LEU 27.A N ILE 23.A O no hydrogen 3.357 N/A VAL 28.A N SER 24.A O no hydrogen 2.909 N/A ALA 29.A N ALA 25.A O no hydrogen 2.981 N/A ILE 30.A N LYS 26.A O no hydrogen 3.035 N/A MET 31.A N LEU 27.A O no hydrogen 3.020 N/A ASP 32.A N VAL 28.A O no hydrogen 2.769 N/A SER 33.A N ALA 29.A O no hydrogen 3.041 N/A SER 33.A OG.A ALA 29.A O no hydrogen 3.226 N/A LEU 34.A N ILE 30.A O no hydrogen 3.201 N/A PHE 35.A N MET 31.A O no hydrogen 2.881 N/A ASP 36.A N ASP 32.A O no hydrogen 2.948 N/A LYS 37.A N SER 33.A O no hydrogen 2.968 N/A LEU 38.A N LEU 34.A O no hydrogen 2.883 N/A LEU 39.A N PHE 35.A O no hydrogen 2.828 N/A SER 40.A N ASP 36.A O no hydrogen 3.142 N/A SER 40.A OG.A ASP 36.A O no hydrogen 2.622 N/A SER 40.A OG.A ASP 36.A OD1 no hydrogen 3.222 N/A SER 40.A OG.B ASP 36.A O no hydrogen 2.923 N/A SER 40.A OG.B LYS 37.A O no hydrogen 3.216 N/A LYS 41.A N LEU 38.A O no hydrogen 3.180 N/A TYR 42.A N LEU 39.A O no hydrogen 3.205 N/A TYR 42.A OH ASP 114.A OD2 no hydrogen 2.815 N/A SER 50.A N ASP 114.A OD1 no hydrogen 2.922 N/A SER 50.A OG ASP 114.A OD1 no hydrogen 3.433 N/A SER 50.A OG ASP 114.A OD2 no hydrogen 2.640 N/A PHE 53.A N SER 50.A OG no hydrogen 3.236 N/A ARG 54.A N SER 50.A O no hydrogen 2.868 N/A ARG 54.A NH1 PRO 49.A O no hydrogen 2.907 N/A ASN 55.A N PRO 51.A O no hydrogen 2.990 N/A ILE 56.A N CYS 52.A O no hydrogen 2.970 N/A CYS 57.A N PHE 53.A O no hydrogen 2.895 N/A CYS 57.A SG PHE 53.A O no hydrogen 3.301 N/A LYS 58.A N ARG 54.A O no hydrogen 2.878 N/A GLN 59.A N ASN 55.A O no hydrogen 3.019 N/A MET 60.A N ILE 56.A O no hydrogen 2.969 N/A THR 61.A N CYS 57.A O no hydrogen 2.978 N/A THR 61.A OG1.A CYS 57.A O no hydrogen 2.999 N/A THR 61.A OG1.B CYS 57.A O no hydrogen 3.168 N/A THR 61.A OG1.B ASN 121.A OD1 no hydrogen 3.373 N/A LYS 62.A N LYS 58.A O no hydrogen 2.912 N/A MET 63.A N GLN 59.A O no hydrogen 2.840 N/A HIS 64.A N MET 60.A O no hydrogen 3.009 N/A HIS 64.A NE2 LYS 126.A O no hydrogen 2.898 N/A GLU 65.A N THR 61.A O no hydrogen 2.982 N/A ALA 66.A N LYS 62.A O no hydrogen 2.961 N/A ILE 67.A N MET 63.A O no hydrogen 3.096 N/A LEU 70.A N ILE 67.A O no hydrogen 2.927 N/A LEU 71.A N ILE 67.A O no hydrogen 3.037 N/A THR 76.A N PRO 72.A O no hydrogen 3.039 N/A THR 76.A OG1 PRO 72.A O no hydrogen 3.274 N/A GLN 77.A N GLU 73.A O no hydrogen 2.922 N/A GLN 77.A NE2 GLY 127.A O no hydrogen 2.909 N/A MET 78.A N GLU 74.A O no hydrogen 2.941 N/A LEU 79.A N GLN 75.A O no hydrogen 2.861 N/A PHE 80.A N THR 76.A O no hydrogen 3.038 N/A LEU 81.A N GLN 77.A O no hydrogen 2.948 N/A ARG 82.A N MET 78.A O no hydrogen 3.140 N/A ILE 83.A N LEU 79.A O no hydrogen 2.929 N/A ASN 84.A N PHE 80.A O no hydrogen 2.828 N/A ASN 84.A ND2 TYR 118.A OH no hydrogen 2.718 N/A ALA 85.A N LEU 81.A O no hydrogen 2.994 N/A SER 86.A N ARG 82.A O no hydrogen 3.098 N/A SER 86.A OG ASP 32.A OD1 no hydrogen 2.715 N/A TYR 87.A N ILE 83.A O no hydrogen 2.929 N/A LYS 88.A N ASN 84.A O no hydrogen 2.952 N/A LYS 88.A NZ LEU 133.A O no hydrogen 2.883 N/A LYS 88.A NZ ASN 134.A O no hydrogen 3.177 N/A LYS 88.A NZ GLU 137.A OE1 no hydrogen 2.675 N/A LEU 89.A N ALA 85.A O no hydrogen 3.049 N/A HIS 90.A N SER 86.A O no hydrogen 3.107 N/A HIS 90.A NE2 ASP 32.A OD1 no hydrogen 2.597 N/A LEU 91.A N TYR 87.A O no hydrogen 2.838 N/A LYS 92.A N LYS 88.A O no hydrogen 2.810 N/A LYS 92.A NZ GLU 140.A O no hydrogen 3.151 N/A LYS 93.A N LEU 89.A O no hydrogen 3.056 N/A GLN 94.A N HIS 90.A O no hydrogen 3.167 N/A GLN 94.A NE2 SER 40.A O no hydrogen 3.482 N/A GLN 94.A NE2 TYR 42.A O no hydrogen 2.880 N/A LEU 95.A N LEU 91.A O no hydrogen 2.901 N/A SER 96.A N LYS 92.A O no hydrogen 3.028 N/A SER 96.A OG.A LYS 92.A O no hydrogen 3.267 N/A HIS 97.A N LYS 93.A O no hydrogen 2.943 N/A LEU 98.A N GLN 94.A O no hydrogen 2.864 N/A ASN 99.A N SER 96.A O no hydrogen 3.105 N/A VAL 100.A N LEU 95.A O no hydrogen 2.997 N/A ASN 102.A ND2 ASN 108.A OD1 no hydrogen 3.046 N/A ASP 103.A N ILE 101.A O no hydrogen 3.004 N/A GLY 104.A N ASN 108.A OD1 no hydrogen 2.775 N/A GLY 105.A N ASP 103.A OD1 no hydrogen 2.945 N/A GLY 109.A N GLY 105.A O no hydrogen 2.858 N/A LEU 110.A N PRO 106.A O no hydrogen 2.961 N/A VAL 111.A N GLN 107.A O no hydrogen 3.196 N/A THR 112.A N ASN 108.A O no hydrogen 2.888 N/A THR 112.A OG1 ASN 108.A O no hydrogen 3.114 N/A ALA 113.A N GLY 109.A O no hydrogen 2.941 N/A ASP 114.A N LEU 110.A O no hydrogen 2.942 N/A VAL 115.A N VAL 111.A O no hydrogen 2.807 N/A ALA 116.A N THR 112.A O no hydrogen 2.874 N/A PHE 117.A N ALA 113.A O no hydrogen 3.070 N/A TYR 118.A N ASP 114.A O no hydrogen 3.087 N/A THR 119.A N VAL 115.A O no hydrogen 2.837 N/A THR 119.A OG1.A VAL 115.A O no hydrogen 3.069 N/A THR 119.A OG1.B VAL 115.A O no hydrogen 3.348 N/A THR 119.A OG1.B ALA 116.A O no hydrogen 3.288 N/A GLY 120.A N ALA 116.A O no hydrogen 3.021 N/A ASN 121.A N PHE 117.A O no hydrogen 2.915 N/A LEU 122.A N TYR 118.A O no hydrogen 2.984 N/A GLN 123.A N THR 119.A O no hydrogen 2.892 N/A GLN 123.A NE2 LEU 131.A O no hydrogen 3.086 N/A ALA 124.A N GLY 120.A O no hydrogen 3.068 N/A LEU 125.A N LEU 122.A O no hydrogen 3.074 N/A LEU 128.A N LEU 125.A O no hydrogen 3.002 N/A LYS 129.A NZ ASP 130.A OD2 no hydrogen 3.262 N/A LEU 131.A N LEU 128.A O no hydrogen 3.230 N/A GLU 137.A N ASN 134.A O no hydrogen 3.293 N/A ILE 138.A N MET 135.A O no hydrogen 3.081 N/A TRP 139.A N ALA 136.A O no hydrogen 3.195 N/A GLU 140.A N GLU 137.A O no hydrogen 3.094 N/A